SCHEMBL7915908

SCHEMBL7915908

CCCCC(C(=O)OCCC)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.49
KDM4E B2RXH2 1/20 0.48
CHRM1 P11229 2/20 0.48
POLB P06746 1/20 0.47
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
GPR88 Q9GZN0 2/20 0.44
TSHR P16473 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CYP3A4 P08684 2/20 0.43
CHRM2 P08172 1/20 0.43
CHRM3 P20309 1/20 0.43
CA2 P00918 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7919739 0.94 TSHR (0.51) LMNAKDM4ECHRM1POLBALDH1A1
SCHEMBL2288534 0.92 NPC1 (0.55) LMNAKDM4ECHRM1ALDH1A1SMN1; SMN2
SCHEMBL2291173 0.91 NPC1 (0.56) LMNAKDM4EPOLBALDH1A1SMN1; SMN2
SCHEMBL2290980 0.91 NPC1 (0.56) LMNAKDM4EPOLBALDH1A1SMN1; SMN2
SCHEMBL7906140 0.91 NPC1 (0.56) LMNAKDM4EPOLBALDH1A1SMN1; SMN2
SCHEMBL4206097 0.89 MMP8 (0.50) POLBALDH1A1SMN1; SMN2NPC1GPR88
SCHEMBL11871815 0.89 POLB (0.48) LMNAKDM4ECHRM1POLBALDH1A1
SCHEMBL27478078 0.88 NPC1 (0.52) LMNAALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL3929627 0.88 NPC1 (0.56) LMNAKDM4EPOLBALDH1A1SMN1; SMN2
SCHEMBL11296489 0.88 NPC1 (0.56) LMNAKDM4EPOLBALDH1A1SMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6207739-B1 Polyamide acid composition containing metal, polyimide film, flexible printed wiring board and method for producing them KANEGAFUCHI KAGAKU KOGYO KABUSHIKI (JP) 2001-03-27 US disclosed